canSAR628949
FEATURES
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NAMES
    SMILES
    O=C(CSc1nnc(-c2ccc(/N=C\c3ccc(Cl)cc3)cc2)o1)Nc1cccc([N+](=O)[O-])c1
    InChI
    InChI=1S/C23H16ClN5O4S/c24-17-8-4-15(5-9-17)13-25-18-10-6-16(7-11-18)22-27-28-23(33-22)34-14-21(30)26-19-2-1-3-20(12-19)29(31)32/h1-13H,14H2,(H,26,30)/b25-13-
    MOLECULAR FORMULA
    C23H16ClN5O4S
    CROSS REFERENCES
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    canSAR628949
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight493.06
    AlogP5.78
    HBond donors1
    HBond acceptors9
    Atoms50
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR628949.